Esfenvalerate

CAT: 1596-AR-E10388-04Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-E10388-04Size:100 Units

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CAS Number

66230-04-4

Synonyms

(S) -Cyano (3-phenoxyphenyl) methyl (S) -2- (4-chlorophenyl) -3-methylbutanoate

Molecular Formula

C25H22ClNO3

Molecular Weight

419.91

API Name

Esfenvalerate

Chemical Information

Esfenvalerate

Esfenvalerate is a fenvalerate. It has a role as an agrochemical and a pyrethroid ester insecticide.

CAS Number	66230-04-4
PubChem CID	10342051
IUPAC Name	[(S)-cyano-(3-phenoxyphenyl)methyl] (2S)-2-(4-chlorophenyl)-3-methylbutanoate
Molecular Formula	C25H22ClNO3
Molecular Weight	419.9
XLogP	6.2
Topological Polar Surface Area	59.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	30
Formal Charge	0
Complexity	586

SMILES

CC(C)[C@@H](C1=CC=C(C=C1)Cl)C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1

InChIKey

NYPJDWWKZLNGGM-RPWUZVMVSA-N

Chemical Structure

2D Structure

CAS: 66230-04-4

CID: 10342051

Formula: C25H22ClNO3

MW: 419.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	419.9
XLogP3	6.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	419.1288213
Monoisotopic Mass	419.1288213
Topological Polar Surface Area	59.3 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	586
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
T19751-01	Esfenvalerate
HY-129257R-01	Esfenvalerate (Standard)
CS-O-54897	Esfenvalerate-d7
S-0351-ACN	Asana (Esfenvalerate) - EACH
CS-O-64393	Esfenvalerate-d7 (Racemic)
S-0351	Asana (Esfenvalerate) - 1ML
S-0351-AC	1000 ug/mL Asana (Esfenvalerate) in Acetone Volume: 1mL Ampule - 1ML